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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Neuropeptide S receptor
Species	Homo sapiens (Human)
Gene	NPSR1
Synonym	G-protein coupled receptor for asthma susceptibility vasopressin receptor-related receptor 1 G protein-coupled receptor 154 PGR14 NPS receptor G-protein coupled receptor 154 GPR154 G-protein coupled receptor PGR14 VRR1 [ Show all ]
Disease	Neurological disease
Length	371
Amino acid sequence	MPANFTEGSFDSSGTGQTLDSSPVACTETVTFTEVVEGKEWGSFYYSFKTEQLITLWVLFVFTIVGNSVVLFSTWRRKKKSRMTFFVTQLAITDSFTGLVNILTDINWRFTGDFTAPDLVCRVVRYLQVVLLYASTYVLVSLSIDRYHAIVYPMKFLQGEKQARVLIVIAWSLSFLFSIPTLIIFGKRTLSNGEVQCWALWPDDSYWTPYMTIVAFLVYFIPLTIISIMYGIVIRTIWIKSKTYETVISNCSDGKLCSSYNRGLISKAKIKAIKYSIIIILAFICCWSPYFLFDILDNFNLLPDTQERFYASVIIQNLPALNSAINPLIYCVFSSSISFPCREQRSQDSRMTFRERTERHEMQILSKPEFI
UniProt	Q6W5P4
Protein Data Bank	N/A
GPCR-HGmod model	Q6W5P4
3D structure model	This predicted structure model is from GPCR-EXP Q6W5P4.
BioLiP	N/A
Therapeutic Target Database	T20958
ChEMBL	CHEMBL5162
IUPHAR	302
DrugBank	BE0000948

Ligand

Name	SR-01000697372
Molecular formula	C21H17N3O2S
IUPAC name	4-hydroxy-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide
Molecular weight	375.446
Hydrogen bond acceptor	5
Hydrogen bond donor	3
XlogP	4.4
Synonyms	4-hydroxy-N-[1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide MLS000374694 BDBM65954 SR-01000697372-3 cid_3307928 4-oxidanyl-N-[1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide SMR000242111 4-hydroxy-N-[(E)-1-(10H-phenothiazin-2-yl)ethylideneamino]benzamide cid_9663733 AB00717782-01 CHEMBL3193568 [ Show all ]
Inchi Key	ADFBGCZUZKLTKQ-YDZHTSKRSA-N
Inchi ID	InChI=1S/C21H17N3O2S/c1-13(23-24-21(26)14-6-9-16(25)10-7-14)15-8-11-20-18(12-15)22-17-4-2-3-5-19(17)27-20/h2-12,22,25H,1H3,(H,24,26)/b23-13+
PubChem CID	9663733
ChEMBL	CHEMBL3193568
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Potency	12589.3 nM	PubChem BioAssay data set	ChEMBL

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